[(1S)-2-oxidanylidenecyclopentyl] 5-(2,3-dihydroindol-1-ylsulfonyl)-2-methoxy-benzoate

Systemtic Name: [(1S)-2-oxidanylidenecyclopentyl] 5-(2,3-dihydroindol-1-ylsulfonyl)-2-methoxy-benzoate Openeye Name: [(1S)-2-oxocyclopentyl] 5-indolin-1-ylsulfonyl-2-methoxy-benzoate CAS Name: 5-(2,3-dihydroindol-1-ylsulfonyl)-2-methoxybenzoic acid [(1S)-2-oxocyclopentyl] ester IUPAC Name: [(1S)-2-oxocyclopentyl] 5-(2,3-dihydroindol-1-ylsulfonyl)-2-methoxybenzoate Traditional Name: 5-indolin-1-ylsulfonyl-2-methoxy-benzoic acid [(1S)-2-ketocyclopentyl] ester Formula: C21H21NO6S MolecularWeight: 415.45954

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCC3=CC=CC=C32)C(=O)OC4CCCC4=O

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCC3=CC=CC=C32)C(=O)O[C@H]4CCCC4=O

InChI

InChI=1S/C21H21NO6S/c1-27-19-10-9-15(13-16(19)21(24)28-20-8-4-7-18(20)23)29(25,26)22-12-11-14-5-2-3-6-17(14)22/h2-3,5-6,9-10,13,20H,4,7-8,11-12H2,1H3/t20-/m0/s1